COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL064967
Chemical Name: 2-phenylethyl4-{[(3-cyanophenyl)carbamothioyl]amino}-4-oxobutanoate
Smiles: N#Cc1cccc(c1)NC(=S)NC(=O)CCC(=O)OCCc1ccccc1

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Molecular Weight: 381.46
Empirical Formula: C20H19N3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.56
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 2

     

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